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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02465850

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
NPOP-NITROPHENOLA,B1Z440.85
NPOP-NITROPHENOLX2ZYW0.85
NPOP-NITROPHENOLH,L1YEK0.85
NPOP-NITROPHENOLA,C,E,G43CA0.85
NPOP-NITROPHENOLA1LS60.85
NPOP-NITROPHENOLX2ZVP0.85
NPOP-NITROPHENOLA,B2I100.85
NPOP-NITROPHENOLA1VAH0.85
NPOP-NITROPHENOLA,B3ETT0.85
NPOP-NITROPHENOLA,B2D200.85
NPOP-NITROPHENOLX2ZYV0.85
4NS4-nitrophenyl sulfateX2ZYU0.8
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMP1E2S0.84
CSNN,4-DIHYDROXY-N-OXO-3-(SULFOOXY)BENZENAMINIUMA1PA90.84
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A,B,D,F1KNO0.76
PNPMETHYL-PHOSPHONIC ACID MONO-(4-
NITRO-PHENYL) ESTER
A1ZED0.76
DNC3,5-DINITROCATECHOLA3BWY0.87
DNC3,5-DINITROCATECHOLA3BWM0.87
DNC3,5-DINITROCATECHOLA1VID0.87
EDREDROPHONIUM IONA1AX90.7
EDREDROPHONIUM IONA2ACK0.7
4NL4-AMINOPHENOLA2ORL0.78
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.73
4NC4-NITROCATECHOLA1NO30.87
4NC4-NITROCATECHOLB2BUU0.87
4NC4-NITROCATECHOLB2BUZ0.87
4NC4-NITROCATECHOLB1EOC0.87
4NP4-NITROPHENYL PHOSPHATEA,B1D1Q0.78
4NP4-NITROPHENYL PHOSPHATEA,B1VE70.78
4NP4-NITROPHENYL PHOSPHATEA2I6P0.78
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1GAF0.73
NPE5-(PARA-NITROPHENYL PHOSPHONATE)-
PENTANOIC ACID
H1AJ70.73
NCR2-NITRO-P-CRESOLA,B1AHV0.74
2AF2-AMINOPHENOLA1L4N0.74
B4Nbis(4-nitrophenyl) hydrogen phosphateA3DH80.75
DNT2-[1-METHYLHEXYL]-4,6-DINITROPHENOLA,B,C1NEN0.74
TNFPICRIC ACIDA1GVS0.85
TNFPICRIC ACIDX1VYP0.85
TNFPICRIC ACIDA1VYR0.85
TNFPICRIC ACIDX1VYS0.85
NCHP-NITROPHENYL-PHOSPHOCHOLINEL1DL70.71
DNF2,4-DINITROPHENOLA,B2B160.86
DNF2,4-DINITROPHENOLH,J,L,N1OAU0.86
DNF2,4-DINITROPHENOLA1GVO0.86
DNF2,4-DINITROPHENOLA,B2B150.86
DNF2,4-DINITROPHENOLA,B2B140.86
ANX2,5-DINITROPHENOLA,B,C,D,E,F,
G,H
2BFG0.85